1-ethyl-N-(3-fluorophenyl)piperidin-4-amine

C13H19FN2 — CID 867433

IUPAC1-ethyl-N-(3-fluorophenyl)piperidin-4-amine
SMILESCCN1CCC(Nc2cccc(F)c2)CC1
InChIInChI=1S/C13H19FN2/c1-2-16-8-6-12(7-9-16)15-13-5-3-4-11(14)10-13/h3-5,10,12,15H,2,6-9H2,1H3
InChIKeyGDHPDLRAKHREAS-UHFFFAOYSA-N
MW222.31 g/mol
LogP2.72
Rot. Bonds3

About 1-ethyl-N-(3-fluorophenyl)piperidin-4-amine

1-ethyl-N-(3-fluorophenyl)piperidin-4-amine (PubChem CID 867433) has the molecular formula C13H19FN2 and a molecular weight of 222.31 g/mol. Its IUPAC name is 1-ethyl-N-(3-fluorophenyl)piperidin-4-amine.

Molecular Properties

Compound Name1-ethyl-N-(3-fluorophenyl)piperidin-4-amine
PubChem CID867433
Molecular FormulaC13H19FN2
Molecular Weight222.31 g/mol
Exact Mass222.15
IUPAC Name1-ethyl-N-(3-fluorophenyl)piperidin-4-amine
SMILESCCN1CCC(Nc2cccc(F)c2)CC1
InChIInChI=1S/C13H19FN2/c1-2-16-8-6-12(7-9-16)15-13-5-3-4-11(14)10-13/h3-5,10,12,15H,2,6-9H2,1H3
InChIKeyGDHPDLRAKHREAS-UHFFFAOYSA-N
XLogP2.72
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.31
LogP ≤ 52.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-ethyl-N-(3-fluorophenyl)piperidin-4-amine?
The IUPAC name of 1-ethyl-N-(3-fluorophenyl)piperidin-4-amine (CID 867433) is 1-ethyl-N-(3-fluorophenyl)piperidin-4-amine.
What is the SMILES notation for 1-ethyl-N-(3-fluorophenyl)piperidin-4-amine?
The canonical SMILES for 1-ethyl-N-(3-fluorophenyl)piperidin-4-amine is CCN1CCC(Nc2cccc(F)c2)CC1.
What is the InChIKey of 1-ethyl-N-(3-fluorophenyl)piperidin-4-amine?
The InChIKey is GDHPDLRAKHREAS-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19FN2/c1-2-16-8-6-12(7-9-16)15-13-5-3-4-11(14)10-13/h3-5,10,12,15H,2,6-9H2,1H3.
What are the key properties of 1-ethyl-N-(3-fluorophenyl)piperidin-4-amine?
1-ethyl-N-(3-fluorophenyl)piperidin-4-amine has a molecular weight of 222.31 g/mol, XLogP of 2.72, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-N-(3-fluorophenyl)piperidin-4-amine is sourced from PubChem (CID 867433), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).